2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)pyridine-3-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)pyridine-3-carboxamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)pyridine-3-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-pyridinecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)pyridine-3-carboxamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(6-methoxy-1,3-benzothiazol-2-yl)nicotinamide Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N=CC=C3)SC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N=CC=C3)SC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H17N3O4S2/c1-27-13-4-6-16-19(11-13)31-22(24-16)25-20(26)15-3-2-8-23-21(15)30-14-5-7-17-18(12-14)29-10-9-28-17/h2-8,11-12H,9-10H2,1H3,(H,24,25,26)